Halofuginone

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Properties Simple | Detailed

Formula C16H17BrClN3O3
IUPAC Name 7-bromo-6-chloro-3-[3-[(2r,3r)-3-hydroxy-2-piperidyl]-2-oxo-propyl]quinazolin-4-one
Molecular Mass 414.681 g·mol−1
Heat of Formation -394.4 ± 16.7 kJ·mol−1
Dipole Moment 6.35 ± 1.08 D
Volume 407.11 Å 3
Surface Area 350.47 Å 2
HOMO Energy -9.27 ± 0.55 eV
LUMO Energy -1.16 ± eV
Point Group Symmetry C1
InChIKey LVASCWIMLIKXLA-HUUCEWRRSA-N
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Elements C Cl H O N Br